3-Aminopyrrolidine dihydrochloride - CAS 103831-11-4
Catalog: |
BB001230 |
Product Name: |
3-Aminopyrrolidine dihydrochloride |
CAS: |
103831-11-4 |
Synonyms: |
pyrrolidin-3-amine;dihydrochloride |
IUPAC Name: | pyrrolidin-3-amine;dihydrochloride |
Description: | 3-Aminopyrrolidine dihydrochloride (CAS# 103831-11-4) is a useful research chemical. |
Molecular Weight: | 159.06 |
Molecular Formula: | C4H10N2 · 2HCl |
Canonical SMILES: | C1CNCC1N.Cl.Cl |
InChI: | InChI=1S/C4H10N2.2ClH/c5-4-1-2-6-3-4;;/h4,6H,1-3,5H2;2*1H |
InChI Key: | NJPNCMOUEXEGBL-UHFFFAOYSA-N |
Boiling Point: | 214.5 °C at 760 mmHg |
Density: | 1.413 g/cm3 |
Storage: | Inert atmosphere, Room Temperature |
MDL: | MFCD00060176 |
LogP: | 1.94010 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112574087-A | Synthetic method of 3-aminopyrrolidine hydrochloride | 20201221 |
WO-2020070610-A1 | Novel oxadiazoles | 20181001 |
TW-202028196-A | Novel oxadiazoles | 20181001 |
EP-3860992-A1 | Novel oxadiazoles | 20181001 |
KR-20210098949-A | new oxadiazole | 20181001 |
Complexity: | 44.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.0377538 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.0377538 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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Nitrogen Compounds
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